MDPI-ZINC03850004 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 0.0210 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.4710 -0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9100 -1.5610 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 0.0340 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4970 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7340 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0090 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.5190 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -0.0250 -1.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1740 1.0650 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5340 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9460 -0.1910 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.0660 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -2.5730 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -2.0420 -1.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6150 -0.5320 -1.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2210 -0.0280 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -0.3270 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -1.6390 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -2.5510 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -3.4940 -2.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -2.4660 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 0.0260 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -0.8360 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -0.2160 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 0.6240 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 1.1920 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 0.9200 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 0.0790 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 -0.4930 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1600 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.6000 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 1.1110 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -0.3390 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 1.1230 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.3180 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.0990 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.3440 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1550 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -1.6090 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -2.3980 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.4490 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -3.6620 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -2.2510 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -0.1450 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 0.5060 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -2.0810 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -1.4460 -4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -2.0500 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 -2.0960 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -3.5540 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -0.9750 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 -1.8010 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 0.8360 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 1.8480 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0500 1.3640 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2830 -0.1330 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 -1.1520 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 M END